Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | DHPS | P49366 | 1/20 | 0.40 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9213558 | 0.86 | ACHE (0.42) | ACHECACNA1IALDH1A1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL9213433 | 0.85 | ACHE (0.41) | ACHECACNA1IALDH1A1MAPTKMT2A | |
| SCHEMBL9214452 | 0.84 | GRM5 (0.40) | CHRNB2CHRNA4GRM5 | |
| SCHEMBL9215804 | 0.83 | GRM5 (0.39) | KDM4ECHRNB2CHRNA4GRM5KMT2A | |
| Hydrochloric Acid SCHEMBL9214335 | 0.83 | GRM5 (0.39) | CHRNB2CHRNA4GRM5 | |
| SCHEMBL9214121 | 0.81 | CHRNB2 (0.46) | CACNA1IKDM4ETRPV6ALDH1A1CHRNB2 | |
| SCHEMBL9215061 | 0.80 | ACHE (0.46) | ACHEKDM4E | |
| SCHEMBL9213007 | 0.79 | GRM5 (0.38) | ACHEGRM5 | |
| Hydrochloric Acid SCHEMBL9216230 | 0.78 | GRM5 (0.37) | ACHEGRM5 | |
| SCHEMBL9215461 | 0.76 | BCHE (0.56) | ACHEKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |